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NaMn5O8 phase diagram · Files on Ouro

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NaMn5O8 phase diagram

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Phase diagram of NaMn5O8 with Orb v3 conservative inf MPA; e_above_hull: 0.059028 eV/atom; predicted_stable: False

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template-NaMn5O8 - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -100.0418 eV; energy change = -0.6552 eV; symmetry: R-3m → R-3m

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Calculate energy above the convex hull